General Information of the Compound
| Compound ID |
CP0523071
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1'-[(4-methyl-1,2,4-triazol-3-yl)methyl]-1-quinolin-3-ylspiro[indole-3,4'-piperidine]-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C25H24N6O
|
||||||||||||||||||
| Molecular Weight |
424.508
|
||||||||||||||||||
| Canonical SMILES |
Cn1cnnc1CN1CCC2(CC1)C(=O)N(c1ccccc21)c1cnc2ccccc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C25H24N6O/c1-29-17-27-28-23(29)16-30-12-10-25(11-13-30)20-7-3-5-9-22(20)31(24(25)32)19-14-18-6-2-4-8-21(18)26-15-19/h2-9,14-15,17H,10-13,16H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
XAVXRMMYQLWKCY-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound